Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate
TL;DR: Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate (CAS 20073-24-9) is a chemical compound with molecular formula C14H10O5 and molecular weight 258.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-oxofuro[3,2-g]chromene-6-carboxylate
Also Known As: 3-CARBETHOXYPSORALEN, 3-CPs, 3-Ethoxycarbonylpsoralen, Ethyl 3-psoralencarboxylate, 3-Carbethoxy-psoralen
| Molecular Formula | C14H10O5 |
|---|---|
| Molecular Weight | 258.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.05283 |
| Heavy Atoms | 19 |
| Complexity | 428.0 |
| Solubility | less than 1 mg/mL at 66 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 20073-24-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C3C(=C2)C=CO3)OC1=O |
| InChIKey | CFQAMEDTKHNQTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate (CAS 20073-24-9), with molecular formula C14H10O5 and molecular weight 258.05 g/mol. IUPAC: ethyl 7-oxofuro[3,2-g]chromene-6-carboxylate.
Chemical Property Profile of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate
Property Insights of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate. Following Lipinski's Rule of Five, Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate?
The CAS number of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate is 20073-24-9.
What is the molecular formula of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate?
The molecular formula of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate is C14H10O5.
What is the molecular weight of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate?
The molecular weight of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate is 258.05 g/mol.
Where can I buy Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate?
You can request a quote for Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.